ethyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-4-cyclopropyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-4-cyclopropyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-4-cyclopropyl-thiophene-3-carboxylate CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-4-cyclopropyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-4-cyclopropylthiophene-3-carboxylate Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoylamino]-4-cyclopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H20ClNO3S2 MolecularWeight: 409.95

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClNO3S2/c1-2-24-19(23)17-15(12-3-4-12)11-26-18(17)21-16(22)9-10-25-14-7-5-13(20)6-8-14/h5-8,11-12H,2-4,9-10H2,1H3,(H,21,22)